| SpectraBase Spectrum ID |
8xs1m7e9aG2 |
| Name |
21H-Biline-3-acetic acid, 17-ethyl-1,2,3,19,23,24-hexahydro-2,2,7,8,13,18-hexamethyl-1,19-dioxo-12-[3-oxo-3-[[2-[[(phenylmethoxy)carbonyl]amino]ethyl]amino]propyl]-, methyl ester, (.+-.)- |
| CAS Registry Number |
129133-58-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H52N6O7 |
| InChI |
InChI=1S/C43H52N6O7/c1-9-29-27(5)40(52)48-35(29)21-34-26(4)30(15-16-38(50)44-17-18-45-42(54)56-23-28-13-11-10-12-14-28)36(47-34)20-32-24(2)25(3)33(46-32)22-37-31(19-39(51)55-8)43(6,7)41(53)49-37/h10-14,20-22,31,47H,9,15-19,23H2,1-8H3,(H,44,50)(H,45,54)(H,48,52)(H,49,53)/b32-20-,35-21-,37-22- |
| InChIKey |
QXRAXXQSTJEUCI-HTJRKWKSSA-N |
| Molecular Weight |
764.924 g/mol |
| SMILES |
N1C(C(C(\C1=C/C1=N\C(=C/c2c(CCC(=O)NCCNC(=O)OCc3ccccc3)c(C)c([nH]2)\C=C/2NC(C(=C2CC)C)=O)C(=C1C)C)CC(=O)OC)(C)C)=O |
| SPLASH |
splash10-0a6u-9550000000-0cebaaa1a986e5024a05 |
| Source of Spectrum |
AH-121-217-9 |
| Synonyms |
1,19-Dioxo-17-ethyl-3-methoxycarbonylmethyl-2,2,7,8,13,18-hexamethyl-1,2,3,19,23,24-hexahydro-21H-bilin-8-(N-benzyloxycarbonyl-aminoethyl)-propylamide
Methyl ((2Z)-2-{[(2Z)-2-({3-{3-[(2-{[(benzyloxy)carbonyl]amino}ethyl)amino]-3-oxopropyl}-5-[(Z)-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-4-methyl-1H-pyrrol-2-yl}methylene)-3,4-dimethyl-2H-pyrrol-5-yl]methylene}-4,4-dimethyl-5-oxopyrrolidinyl)acetate |
| Wiley ID |
1416604 |
![21H-Biline-3-acetic acid, 17-ethyl-1,2,3,19,23,24-hexahydro-2,2,7,8,13,18-hexamethyl-1,19-dioxo-12-[3-oxo-3-[[2-[[(phenylmethoxy)carbonyl]amino]ethyl]amino]propyl]-, methyl ester, (.+-.)-](/api/spectrum/8xs1m7e9aG2/structure.png?h=300&w=458 "21H-Biline-3-acetic acid, 17-ethyl-1,2,3,19,23,24-hexahydro-2,2,7,8,13,18-hexamethyl-1,19-dioxo-12-[3-oxo-3-[[2-[[(phenylmethoxy)carbonyl]amino]ethyl]amino]propyl]-, methyl ester, (.+-.)-")
