ID: 115564
SMILES:C1(C)=CC(c2c(O)c(CC[N+](C)(C)C)cc(C=O)c2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.502
CB1 binding score: -13.633
InChIKey:GMNCVQTVAHGYFE-UHFFFAOYSA-O
ID: 115565
SMILES:C1(O)(C)CCC2C(C)(C)Oc3cc(CCC)c(C(=O)O)c(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -15.195
InChIKey:LTXBLLQYKWIJMR-UHFFFAOYSA-N
ID: 115566
SMILES:c12c(c(O)cc(CCCCC)c1)C13C(CC=C(C)C)(C=CC1(C)O2)CC(CCC=C(C)C)=CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.702
CB1 binding score: -14.357
InChIKey:YAFBTPFDLPRIJI-UHFFFAOYSA-N
ID: 115567
SMILES:C1(C)=CC(=O)CC(C)(C)Oc2cc(C(O)=O)c(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.055
InChIKey:IKPRCGWEQLJDMZ-UHFFFAOYSA-N
ID: 115568
SMILES:c1c(OC)c(C2C=C(C)CCC2C(C)=C)c(O)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.99
InChIKey:JIAMDLHQCKSETM-UHFFFAOYSA-N
ID: 115569
SMILES:C1(C)(C)C2C(c3c(O)cc(CCCCC)cc3OC2(C)C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.295
InChIKey:ZVJPDUNYDFYTAI-UHFFFAOYSA-N
ID: 115570
SMILES:c1(O)cc2c(cc1CCCCC)OC(C)(C)C1C2C(O)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.474
InChIKey:ZSVSFVPHWGNWIT-UHFFFAOYSA-N
ID: 115571
SMILES:C1CC(C)C(C)=C2C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.108
InChIKey:PZBNNZNJTBMYOC-UHFFFAOYSA-N
ID: 115572
SMILES:C1CC(C)=CC(c2c(O)cc(CCCCC)cc2OC)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 115573
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -16.998
InChIKey:DAOBMYOFOPZVGI-UHFFFAOYSA-N
ID: 115574
SMILES:COc1c2c3c(c(C)c1)OC(C)(C)C1CCC(C)=CC3C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -12.362
InChIKey:INPUBDYIKAGJND-UHFFFAOYSA-N
ID: 115575
SMILES:C1C(C(C)C)C(c2c(O)cc(CCC)cc2O)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.712
InChIKey:SBLQFIJJHXJVBQ-UHFFFAOYSA-N
ID: 115576
SMILES:CC1(C)Oc2c(c(O)cc(CCCCCCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -18.138
InChIKey:CUNZWRHOBZASJY-UHFFFAOYSA-N
ID: 115577
SMILES:C1C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.821
InChIKey:CUWJKLPAOPPJHN-UHFFFAOYSA-N
ID: 115578
SMILES:C12=C(C=C(C)CCC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.089
InChIKey:MAUABCKRJLCVCE-UHFFFAOYSA-N
ID: 115579
SMILES:C1(C)(C)CC2C(C1)C(=O)C1(CC(=O)C(=C)C)Oc3cc(CCCCC)cc(CC=C(C)C)c3OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -15.24
InChIKey:GQTUBHIQIXQATD-UHFFFAOYSA-N
ID: 115580
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC(C)=O)C=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.416
InChIKey:NZUGOOUPPNOIQV-UHFFFAOYSA-N
ID: 115581
SMILES:C(c1c(O)c(C)c(OC)c(O)c1C1C(C(=C)C)CCC(C)=C1)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.929
InChIKey:ZVKVQQKTGBZQOJ-UHFFFAOYSA-N
ID: 115582
SMILES:C(N(CC)CC)(c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.467
CB1 binding score: -15.425
InChIKey:KEICITHWGHACAT-UHFFFAOYSA-N
ID: 115583
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)C=C1)CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.366
InChIKey:IGMKNMANGXSVON-UHFFFAOYSA-N
ID: 115584
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c(O)cc(C)c(O)c1-2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.929
InChIKey:LTGGYIJWLGCBLR-UHFFFAOYSA-N