Try beta.chemspider
- Double-bond stereo
- 17 of 18 defined stereocentres
(2S)-2-{(2S,4S,6S)-4-{[6-Deoxy-4-O-(6-deoxy-2-O-methyl-alpha-L-mannopyranosyl)-3-O-methyl-beta-D-allopyranosyl]oxy}-2-hydroxy-5,5-dimethyl-6-[(1E,3Z)-1,3-pentadien-1-yl]tetrahydro-2H-pyran-2-yl}-N-[(2 E,4E,6S,7S,9S,10E,12E,14E,16E)-8,9-dihydroxy-18-(4-hydroxy-1-methyl-2-oxo-1,2-dihydro-3-pyridinyl)-6-methoxy-5,7,17-trimethyl-18-oxo-2,4,10,12,14,16-octadecahexaen-1-yl]butanamide
CC1(C)[C@H](/C=C/C=C\C)O[C@@](O)(C[C@@H]1O[C@@H]1O[C@H](C)[C@@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2OC)[C@@H](OC)[C@H]1O)[C@H](CC)C(=O)NC/C=C/C=C(\C)/[C@@H](OC)[C@@H](C)C(O)[C@@H](O)/C=C/C=C/C=C/C=C(\C)/C(=O)C1C(=O)N(C)C=CC=1O
InChI=1S/C58H86N2O18/c1-14-16-20-28-41-57(8,9)42(76-55-48(67)51(72-12)50(37(7)75-55)77-56-52(73-13)47(66)46(65)36(6)74-56)32-58(70,78-41)38(15-2)53(68)59-30-24-23-26-34(4)49(71-11)35(5)45(64)40(62)27-22-19-17-18-21-25-33(3)44(63)43-39(61)29-31-60(10)54(43)69/h14,16-29,31,35-38,40-42,45-52,55-56,61-62,64-67,70H,15,30,32H2,1-13H3,(H,59,68)/b16-14-,19-17+,21-18+,24-23+,27-22+,28-20+,33-25+,34-26+/t35-,36-,37+,38+,40-,41-,42-,45?,46-,47+,48+,49+,50+,51-,52+,55-,56-,58-/m0/s1
SAOPKAPZHUMVPA-KJUQYEEGSA-N
CSID:88298647, http://www.chemspider.com/Chemical-Structure.88298647.html (accessed 15:09, Jul 6, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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