Name |
LBA 1 |
Formula |
C60H65O36 |
Mw |
1361.32555348 |
CAS RN |
934807-11-1 |
C_ID |
C00034576
,
|
InChIKey |
SOZRHWHFXBRBBE-PHFICDIWNA-O |
InChICode |
InChI=1S/C60H64O36/c61-17-35-44(73)48(77)53(82)58(93-35)90-31-5-1-21(9-27(31)63)4-8-41(70)86-19-37-46(75)50(79)54(83)59(95-37)91-32-6-2-22(10-28(32)64)3-7-40(69)85-18-36-45(74)49(78)52(81)57(94-36)88-24-13-26(62)25-15-34(56(89-33(25)14-24)23-11-29(65)43(72)30(66)12-23)92-60-55(84)51(80)47(76)38(96-60)20-87-42(71)16-39(67)68/h1-15,35-38,44-55,57-61,73-84H,16-20H2,(H6-,62,63,64,65,66,67,68,72)/p+1/b7-3+,8-4+/t35-,36-,37-,38-,44-,45-,46-,47-,48+,49+,50+,51+,52-,53-,54-,55-,57-,58-,59-,60-/m1/s1 |
SMILES |
[C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1COC(=O)/C=C/c1cc(c(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)Oc1c(cc(cc1)/C=C/C(=O)OC[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)Oc1cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)CC(=O)O)O)O)O)c1cc(c(c(c1)O)O)O)O)O)O)O)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Goodeniaceae | Leschenaultia R.Br. cv | Ref. |
|
|
zoom in
Organism | Leschenaultia R.Br. cv | Reference | Saito,Phytochem.,68,(2007),673 |
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