ID: 66151
SMILES:C(=C(CCC=C(C)C)C(=O)O)Cc1c(O)cc(CCCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.768
InChIKey:TZASXMQXYBMTOO-UHFFFAOYSA-N
ID: 66152
SMILES:C1CC(C)(c2ccc3c(c2)C(O)CCC3=O)OC12C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -17.061
InChIKey:QJAUWUDDLSFWMZ-UHFFFAOYSA-N
ID: 66153
SMILES:C(C=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(CO)=CC21)Cc1cc(O)ccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -14.762
InChIKey:WHMZPOOBRAHFJO-UHFFFAOYSA-N
ID: 66154
SMILES:C12C(O)(Cc3c(O)c(C(OC)=O)c(CCCCC)cc3O1)C(C)C(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.491
CB1 binding score: -13.647
InChIKey:DFIDYWTXZBWNHR-UHFFFAOYSA-N
ID: 66155
SMILES:CC1=CC(c2c(O)cc(O)cc2O)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.957
InChIKey:ZSBGNUPOFUYDMQ-UHFFFAOYSA-N
ID: 66156
SMILES:C1(CCc2cc(O)c(CC=C(CCC=C(C)C)C)cc2)=CC(=O)C=C(C)C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -15.875
InChIKey:NFRONDBHSBYBFV-UHFFFAOYSA-N
ID: 66157
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 66158
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 66159
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 66160
SMILES:Oc1c2c(c(C(=O)CC(C)C)c(O)c1)OC(C)(C)C1C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -16.706
InChIKey:PQFWTSUNMDQODD-UHFFFAOYSA-N
ID: 66161
SMILES:CC(=CCCc1c(C(OC)=O)c(O)cc(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 304.43
CB1 binding score: -14.884
InChIKey:AHHJROXTDCKGPL-UHFFFAOYSA-N
ID: 66162
SMILES:C(C)(=CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 312.453
CB1 binding score: -18.585
InChIKey:HVEYNLWUTOKMJT-UHFFFAOYSA-N
ID: 66163
SMILES:C1=C(C)CCC2C1c1c(cc(O)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 66164
SMILES:C12c3c(cc(CCCCC)cc3OC)OC3C(C)(C1=O)C1CC1(C(CO)C2)C(O)C3=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -15.173
InChIKey:MZGNXYPAQBMBCM-UHFFFAOYSA-N
ID: 66165
SMILES:C(C)CCCc1c(C(O)=O)cc(O)c2c1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.801
InChIKey:JMBUSKBXFCKTGD-UHFFFAOYSA-N
ID: 66166
SMILES:C1(C(C)=CC)c2c(c3c(c(O)cc(CCCCC)c3)O1)CC(C(C)=C)C(C=C(C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.637
CB1 binding score: -16.365
InChIKey:NUBQVEXPNPGIDQ-UHFFFAOYSA-N
ID: 66167
SMILES:C(C)C#CCc1cc(O)c2c(c1)OC(CCC1C(C)(C)C(C)C(C)(O2)CC1)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: Not available
InChIKey:IBCWPIHKTKSSGC-UHFFFAOYSA-N
ID: 66168
SMILES:C1(=O)C(C)=CCC(C)(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.148
InChIKey:XIZNBBZQPMDSBN-UHFFFAOYSA-N
ID: 66169
SMILES:CC1(C)CC=C(C)C(O)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.756
InChIKey:HCHCXIIFLMOLSH-UHFFFAOYSA-N
ID: 66170
SMILES:OC1C2(C)OCC(C(C)=C)C2c2c1c(OC)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.035
InChIKey:DPZGZPJFTGVTPS-UHFFFAOYSA-N
ID: 66171
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N