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Basic Information |
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Product Name: | ALSACTIDE |
CAS: | 34765-96-3 |
English Synonyms: | ALSACTIDE |
MDL Number.: | MFCD09837909 |
H bond acceptor: | 50 |
H bond donor: | 30 |
Smile: | CC(C)[C@@H](C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNCCCCN)C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](Cc2c[nH]c3c2cccc3)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](Cc5c[nH]cn5)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CO)NC(=O)[C@H](Cc6ccc(cc6)O)NC(=O)CCN |
InChi: | InChI=1S/C98H153N29O21S/c1-58(2)83(96(147)112-55-80(131)114-67(24-9-12-38-99)86(137)118-68(25-10-13-39-100)87(138)117-66(84(104)135)27-17-44-107-43-16-15-41-102)126-95(146)78-29-19-46-127(78)97(148)72(26-11-14-40-101)115-81(132)54-111-85(136)75(50-61-52-110-65-23-8-7-22-64(61)65)123-88(139)69(28-18-45-109-98(105)106)119-92(143)74(48-59-20-5-4-6-21-59)122-93(144)76(51-62-53-108-57-113-62)124-89(140)70(34-35-82(133)134)120-90(141)71(37-47-149-3)121-94(145)77(56-128)125-91(142)73(116-79(130)36-42-103)49-60-30-32-63(129)33-31-60/h4-8,20-23,30-33,52-53,57-58,66-78,83,107,110,128-129H,9-19,24-29,34-51,54-56,99-103H2,1-3H3,(H2,104,135)(H,108,113)(H,111,136)(H,112,147)(H,114,131)(H,115,132)(H,116,130)(H,117,138)(H,118,137)(H,119,143)(H,120,141)(H,121,145)(H,122,144)(H,123,139)(H,124,140)(H,125,142)(H,126,146)(H,133,134)(H4,105,106,109)/t66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,83-/m0/s1 |
InChiKey: | InChIKey=PWINUODHVVOKEY-CNPAZUJWSA-N |
* If the product has intellectual property rights, a license granted is must or contact us.