Try beta.chemspider
- Double-bond stereo
- 25 of 25 defined stereocentres
(2S,4E,6S,8E,10S,14R,20S,21S,23S,24R,25S,27S,30E,32R,33S)-33-{(2R,3R,4R,6R)-6-[(5R,6R)-6-{(2R,4R,5R,6R)-6-[(2R,3E,7E,9E,11E,15E)-1,2-Dihydroxy-3,7,9,11,15,17-octadecahexaen-1-yl]-4,5-dihydroxytetrahyd ro-2H-pyran-2-yl}-1,5,6-trihydroxy-4-methylenehexyl]-3,4-dihydroxytetrahydro-2H-pyran-2-yl}-23,30-dimethyl-4,8,30-tritriacontatriene-1,2,6,10,14,20,21,24,25,27,32,33-dodecol
C[C@@H](C[C@@H]([C@H](CCCCC[C@H](CCC[C@@H](/C=C/C[C@@H](/C=C/C[C@@H](CO)O)O)O)O)O)O)[C@H]([C@H](C[C@H](CC/C(=C/[C@H]([C@@H]([C@H]1[C@@H]([C@@H](C[C@@H](O1)[C@@H](CCC(=C)[C@H]([C@H]([C@H]2C[C@H]([C@H]([C@@H](O2)[C@H]([C@@H](/C=C/CC/C=C/C=C/C=C/CC/C=C/C=C)O)O)O)O)O)O)O)O)O)O)O)/C)O)O)O
InChI=1S/C70H118O23/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20-33-54(79)64(87)69-67(90)59(84)42-61(93-69)68(91)63(86)45(3)35-37-53(78)60-41-58(83)66(89)70(92-60)65(88)56(81)38-44(2)34-36-50(75)40-57(82)62(85)46(4)39-55(80)52(77)32-21-18-19-25-47(72)26-22-27-48(73)28-23-29-49(74)30-24-31-51(76)43-71/h5-7,10-15,20,23-24,28,30,33,38,46-91H,1,3,8-9,16-19,21-22,25-27,29,31-32,34-37,39-43H2,2,4H3/b7-6+,11-10+,13-12+,15-14+,28-23+,30-24+,33-20+,44-38+/t46-,47+,48-,49-,50-,51-,52-,53+,54+,55-,56+,57-,58+,59+,60+,61+,62+,63+,64-,65-,66+,67+,68-,69-,70-/m0/s1
DUBIHFSXPHJGBY-SYDRBKBDSA-N
CSID:28288454, http://www.chemspider.com/Chemical-Structure.28288454.html (accessed 03:21, Jul 4, 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
Advertisement
Spotlight