Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C40H47NO13 |
| Molecular Weight | 749.8001 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 11 / 11 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@H]3OC[C@@]4(OC(C)=O)[C@@H]3[C@@](C)([C@@H](O)C[C@H]4O)C1=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChIKey=NFVVWDXMPVABHE-KWIOUIIFSA-N
InChI=1S/C40H47NO13/c1-20-25(53-36(49)30(46)29(23-13-9-7-10-14-23)41-35(48)24-15-11-8-12-16-24)18-40(50)34-32-38(6,33(47)31(52-21(2)42)28(20)37(40,4)5)26(44)17-27(45)39(32,19-51-34)54-22(3)43/h7-16,25-27,29-32,34,44-46,50H,17-19H2,1-6H3,(H,41,48)/t25-,26-,27+,29-,30+,31+,32-,34-,38+,39-,40+/m0/s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Preferred Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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4G4X3XLY7B
Created by
admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025
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PRIMARY | |||
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131667460
Created by
admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025
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PRIMARY | |||
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159500-49-9
Created by
admin on Wed Apr 02 17:18:31 GMT 2025 , Edited by admin on Wed Apr 02 17:18:31 GMT 2025
|
PRIMARY |
SUBSTANCE RECORD
![Structure of 4-Desacetyl-2-debenzoyl-[2,4]-oxol Paclitaxel](/img/d046306c-710a-42a5-9fc6-8cdc4014c7df.svg "Structure of 4-Desacetyl-2-debenzoyl-[2,4]-oxol Paclitaxel")