Name |
Cucurbitacin I |
Formula |
C30H42O7 |
Mw |
514.2930537 |
CAS RN |
2222-07-3 |
C_ID |
C00003689
,
|
InChIKey |
NISPVUDLMHQFRQ-BUAHFNFDNA-N |
InChICode |
InChI=1S/C30H42O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,11-13,17,19-20,23,31-32,36-37H,10,14-15H2,1-8H3/b12-11+/t17-,19-,20+,23+,27+,28-,29+,30+/m1/s1 |
SMILES |
C1(=C[C@@H]2C(=CC[C@@H]3[C@]2(C(=O)C[C@]2([C@]3(C[C@H]([C@@H]2[C@](C(=O)/C=C/C(C)(C)O)(O)C)O)C)C)C)C(C1=O)(C)C)O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Begoniaceae | Begonia nantoensis | Ref. |
Plantae | Cruciferae | Iberis amara | Ref. |
Plantae | Cucurbitaceae | Bryonia alba | Ref. |
Plantae | Cucurbitaceae | Bryonia dioica | Ref. |
Plantae | Cucurbitaceae | Citrullus spp. | Ref. |
Plantae | Cucurbitaceae | Ecballium elaterium | Ref. |
Plantae | Plantaginaceae | Gratiola officinalis | Ref. |
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Organism | Gratiola officinalis | Reference | Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter57 |
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