RI01703726 | (3Z)-phytochromobilin,1TMS,isomer#3 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4NC(=O)C(C)C4=CC)[NH]3)C(CCC(=O)[O-])=C2C)N([Si](C)(C)C)C1=O | TMS | 654.2885 | Semi standard non polar | 4925.8574 |
RI01703725 | (3Z)-phytochromobilin,1TMS,isomer#2 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4NC(=O)C(C)C4=CC)N3[Si](C)(C)C)C(CCC(=O)[O-])=C2C)NC1=O | TMS | 654.2885 | Semi standard non polar | 5165.6387 |
RI01703724 | (3Z)-phytochromobilin,1TMS,isomer#1 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C)[NH]3)C(CCC(=O)[O-])=C2C)NC1=O | TMS | 654.2885 | Semi standard non polar | 5006.707 |
RI01703723 | (3Z)-phytochromobilin,2TBDMS,isomer#3 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4NC(=O)C(C)C4=CC)N3[Si](C)(C)C(C)(C)C)C(CCC(=O)[O-])=C2C)N([Si](C)(C)C(C)(C)C)C1=O | TBDMS | 810.4219 | Standard non polar | 5105.729 |
RI01703722 | (3Z)-phytochromobilin,2TBDMS,isomer#2 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C(C)(C)C)[NH]3)C(CCC(=O)[O-])=C2C)N([Si](C)(C)C(C)(C)C)C1=O | TBDMS | 810.4219 | Standard non polar | 4895.1187 |
RI01703721 | (3Z)-phytochromobilin,2TBDMS,isomer#1 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C(C)(C)C)N3[Si](C)(C)C(C)(C)C)C(CCC(=O)[O-])=C2C)NC1=O | TBDMS | 810.4219 | Standard non polar | 5213.7935 |
RI01703720 | (3Z)-phytochromobilin,1TBDMS,isomer#3 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4NC(=O)C(C)C4=CC)[NH]3)C(CCC(=O)[O-])=C2C)N([Si](C)(C)C(C)(C)C)C1=O | TBDMS | 696.3354 | Standard non polar | 4825.2847 |
RI01703719 | (3Z)-phytochromobilin,1TBDMS,isomer#2 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4NC(=O)C(C)C4=CC)N3[Si](C)(C)C(C)(C)C)C(CCC(=O)[O-])=C2C)NC1=O | TBDMS | 696.3354 | Standard non polar | 5191.256 |
RI01703718 | (3Z)-phytochromobilin,1TBDMS,isomer#1 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C(C)(C)C)[NH]3)C(CCC(=O)[O-])=C2C)NC1=O | TBDMS | 696.3354 | Standard non polar | 4938.0977 |
RI01703717 | (3Z)-phytochromobilin,3TMS,isomer#1 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)C(CCC(=O)[O-])=C2C)N([Si](C)(C)C)C1=O | TMS | 798.3675 | Standard non polar | 4623.694 |
RI01703716 | (3Z)-phytochromobilin,2TMS,isomer#3 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4NC(=O)C(C)C4=CC)N3[Si](C)(C)C)C(CCC(=O)[O-])=C2C)N([Si](C)(C)C)C1=O | TMS | 726.328 | Standard non polar | 4751.3823 |
RI01703715 | (3Z)-phytochromobilin,2TMS,isomer#2 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C)[NH]3)C(CCC(=O)[O-])=C2C)N([Si](C)(C)C)C1=O | TMS | 726.328 | Standard non polar | 4532.53 |
RI01703714 | (3Z)-phytochromobilin,2TMS,isomer#1 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)C(CCC(=O)[O-])=C2C)NC1=O | TMS | 726.328 | Standard non polar | 4870.634 |
RI01703713 | (3Z)-phytochromobilin,1TMS,isomer#3 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4NC(=O)C(C)C4=CC)[NH]3)C(CCC(=O)[O-])=C2C)N([Si](C)(C)C)C1=O | TMS | 654.2885 | Standard non polar | 4636.827 |
RI01703712 | (3Z)-phytochromobilin,1TMS,isomer#2 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4NC(=O)C(C)C4=CC)N3[Si](C)(C)C)C(CCC(=O)[O-])=C2C)NC1=O | TMS | 654.2885 | Standard non polar | 5004.665 |
RI01703711 | (3Z)-phytochromobilin,1TMS,isomer#1 | JsmolC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C)[NH]3)C(CCC(=O)[O-])=C2C)NC1=O | TMS | 654.2885 | Standard non polar | 4755.7227 |
RI01703710 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TBDMS,isomer#2 | JsmolCC(C)C(C)CC(O[Si](C)(C)C(C)(C)C)C(C)C1CCC2C3CCC4C=C(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CCC12C | TBDMS | 644.5384 | Standard polar | 3761.895 |
RI01703709 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TBDMS,isomer#1 | JsmolCC(C)C(C)CC(O[Si](C)(C)C(C)(C)C)C(C)C1CCC2C3CCC4CC(O[Si](C)(C)C(C)(C)C)=CCC4(C)C3CCC12C | TBDMS | 644.5384 | Standard polar | 3765.468 |
RI01703708 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TMS,isomer#2 | JsmolCC(C)C(C)CC(O[Si](C)(C)C)C(C)C1CCC2C3CCC4C=C(O[Si](C)(C)C)CCC4(C)C3CCC12C | TMS | 560.4445 | Standard polar | 3567.0657 |
RI01703707 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TMS,isomer#1 | JsmolCC(C)C(C)CC(O[Si](C)(C)C)C(C)C1CCC2C3CCC4CC(O[Si](C)(C)C)=CCC4(C)C3CCC12C | TMS | 560.4445 | Standard polar | 3572.6548 |
RI01703706 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TBDMS,isomer#2 | JsmolCC(C)C(C)CC(O[Si](C)(C)C(C)(C)C)C(C)C1CCC2C3CCC4C=C(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CCC12C | TBDMS | 644.5384 | Semi standard non polar | 3865.4016 |
RI01703705 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TBDMS,isomer#1 | JsmolCC(C)C(C)CC(O[Si](C)(C)C(C)(C)C)C(C)C1CCC2C3CCC4CC(O[Si](C)(C)C(C)(C)C)=CCC4(C)C3CCC12C | TBDMS | 644.5384 | Semi standard non polar | 3846.646 |
RI01703704 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TMS,isomer#2 | JsmolCC(C)C(C)CC(O[Si](C)(C)C)C(C)C1CCC2C3CCC4C=C(O[Si](C)(C)C)CCC4(C)C3CCC12C | TMS | 560.4445 | Semi standard non polar | 3411.3625 |
RI01703703 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TMS,isomer#1 | JsmolCC(C)C(C)CC(O[Si](C)(C)C)C(C)C1CCC2C3CCC4CC(O[Si](C)(C)C)=CCC4(C)C3CCC12C | TMS | 560.4445 | Semi standard non polar | 3388.7986 |
RI01703702 | (22S,24R)-22-hydroxy-5alpha-ergostan-3-one,2TBDMS,isomer#2 | JsmolCC(C)C(C)CC(O[Si](C)(C)C(C)(C)C)C(C)C1CCC2C3CCC4C=C(O[Si](C)(C)C(C)(C)C)CCC4(C)C3CCC12C | TBDMS | 644.5384 | Standard non polar | 3798.439 |