| Name |
Coriarioside A
(-)-Coriarioside A |
| Formula |
C119H188O55 |
| Mw |
2497.19141022 |
| CAS RN |
1187958-24-2 |
| C_ID |
C00047818
, 
|
| InChIKey |
WBVBNDNVNTXVFP-IFKOTRSTNA-N |
| InChICode |
InChI=1S/C119H188O55/c1-22-113(16,172-105-87(144)76(133)69(126)52(8)154-105)36-26-29-49(5)98(149)165-92-54(10)157-107(89(146)82(92)139)174-115(18,24-3)37-27-30-50(6)99(150)166-91-53(9)156-106(88(145)81(91)138)173-114(17,23-2)35-25-28-48(4)97(148)163-67-42-119(110(151)171-109-96(79(136)72(129)60(45-122)161-109)170-104-90(147)94(168-102-85(142)77(134)70(127)58(43-120)158-102)93(55(11)155-104)167-101-83(140)73(130)61(46-123)160-101)57(40-111(67,12)13)56-31-32-64-116(19)38-34-66(112(14,15)63(116)33-39-117(64,20)118(56,21)41-65(119)124)164-108-95(169-103-86(143)78(135)71(128)59(44-121)159-103)80(137)74(131)62(162-108)47-152-100-84(141)75(132)68(125)51(7)153-100/h22-24,28-31,51-55,57-96,100-109,120-147H,1-3,25-27,32-47H2,4-21H3/b48-28+,49-29+,50-30+/t51-,52-,53-,54-,55+,57+,58-,59-,60-,61+,62-,63+,64-,65-,66+,67+,68+,69-,70-,71-,72-,73+,74-,75+,76+,77+,78+,79+,80+,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93+,94+,95-,96-,100-,101+,102+,103+,104+,105+,106+,107+,108+,109+,113-,114-,115-,116+,117-,118-,119-/m1/s1 |
| SMILES |
C1[C@@H]2[C@](C[C@@H](C1(C)C)OC(=O)/C(=C/CC[C@@](C=C)(O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C)OC(=O)/C(=C/CC[C@@](C=C)(O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C)OC(=O)/C(=C/CC[C@](O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C)O)O)O)(C=C)C)/C)O)O)C)/C)O)O)C)/C)([C@@H](C[C@@]1(C2=CC[C@H]2[C@]1(CC[C@@H]1[C@@]2(CC[C@@H](C1(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)C)O)O)O)C)C)C)O)C(=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O[C@@H]1O[C@H]([C@@H]([C@H]1O)O)CO)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Fabaceae | Albizia coriaria  | Ref. |
|
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