Try beta.chemspider
- Double-bond stereo
- 28 of 31 defined stereocentres
(1S,3R,6S,7E,9S,13S,16S,17S,18S,22S,23E)-23-Hydroxy-4-(hydroxymethyl)-3,8,12,18,20,22-hexamethyl-25,27-dioxo-9-({2,3,4,6-tetradeoxy-4-[(methoxycarbonyl)amino]-3-methyl-3-nitro-beta-D-xylo-hexopyranosy l}oxy)-26-oxapentacyclo[22.2.1.0~1,6~.0~13,22~.0~16,21~]heptacosa-4,7,11,14,23-pentaen-17-yl 2,6-dideoxy-alpha-L-arabino-hexopyranosyl-(1->3)-[2,6-dideoxy-4-O-methyl-beta-L-ribo-hexopyranosyl-(1->4)]- 2,6-dideoxy-alpha-L-glycero-hexopyranosyl-(1->3)-2,6-dideoxy-alpha-L-ribo-hexopyranoside
C[C@@]1(C[C@H](O[C@H]2CC=C(C)[C@@H]3C=C[C@H]4[C@H]([C@@H](C)C[C@H](C)[C@@H]4O[C@H]4C[C@@H](O[C@H]5CC(O[C@H]6C[C@H](O)[C@@H](O)[C@H](C)O6)C(O[C@@H]6C[C@@H](O)[C@@H](OC)[C@H](C)O6)[C@H](C)O5)[C@@H](O)[C@H](C)O4)[C@]3(C)C(O)=C3C(=O)[C@@]4(C[C@@H](C)C(CO)=C[C@H]4C=C2C)OC3=O)O[C@H](C)[C@@H]1NC(=O)OC)[N+]([O-])=O |t:68,82|
InChI=1S/C67H100N2O24/c1-29-15-18-45(88-52-27-65(11,69(79)80)60(38(10)87-52)68-64(78)82-14)30(2)20-40-21-39(28-70)33(5)26-67(40)62(76)53(63(77)93-67)61(75)66(12)42(29)17-16-41-54(66)31(3)19-32(4)57(41)91-51-24-46(56(74)35(7)84-51)89-50-25-47(90-48-22-43(71)55(73)34(6)83-48)59(37(9)86-50)92-49-23-44(72)58(81-13)36(8)85-49/h15-17,20-21,31-38,40-52,54-60,70-75H,18-19,22-28H2,1-14H3,(H,68,78)/b29-15+,30-20+,61-53+/t31-,32-,33+,34-,35-,36-,37-,38+,40+,41-,42-,43-,44+,45-,46+,47?,48-,49+,50-,51-,52-,54?,55-,56-,57-,58-,59?,60-,65-,66+,67-/m0/s1
LKSBZILVASNBPF-JPNHBRIQSA-N
CSID:78438716, http://www.chemspider.com/Chemical-Structure.78438716.html (accessed 03:46, 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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