ID: 95950
SMILES:C1(C)=CC2c3c(cc(C)c(Br)c3O)OC(CCC=C(C)C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.376
CB1 binding score: -14.603
InChIKey:WOAQVLFLTDERCG-UHFFFAOYSA-N
ID: 95951
SMILES:C12C(COC(C)=O)=CC(C1)C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.502
InChIKey:RHUZUICPIOYYNV-UHFFFAOYSA-N
ID: 95952
SMILES:c1(O)c2c(ccc1CC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.929
InChIKey:UPNIDEUQSKHBSS-UHFFFAOYSA-N
ID: 95953
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c(c(O)cc(CCCC(O)C)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -12.903
InChIKey:ZQBHIWWXTVVDCV-UHFFFAOYSA-N
ID: 95954
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCC)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.838
InChIKey:MDYDEAHLBNNGGU-UHFFFAOYSA-N
ID: 95955
SMILES:CC1(C)CC(=O)CC2(C)Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.218
InChIKey:NZJAZEIURWPQHP-UHFFFAOYSA-N
ID: 95956
SMILES:C12C(C)(C)Oc3ccccc3C1CC(C)=CCCC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -15.587
InChIKey:GRBMVPRRATZZSV-UHFFFAOYSA-N
ID: 95957
SMILES:c1(C)c(-c2c(COC(=O)C)c3c(cc2C)C(C)(C)C(O)C3)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.668
CB1 binding score: -15.764
InChIKey:LFEIUCGOZSZGCS-UHFFFAOYSA-N
ID: 95958
SMILES:CC1(C)Oc2c(c(O)cc(CCc3ccc(O)cc3)c2)C23C(=C1)C(C)(C(C)CCC=C(C)C)CC(C2=O)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.678
CB1 binding score: -15.804
InChIKey:JQUYTYXCNHFOKR-UHFFFAOYSA-N
ID: 95959
SMILES:C(Cc1c(O)c(C(=O)O)c(CCCCC)cc1O)C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -18.394
InChIKey:CISYTRNYCIFKEX-UHFFFAOYSA-N
ID: 95960
SMILES:O1C2C1(C=O)CCC1C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.585
InChIKey:ITMGEERKSXVBOY-UHFFFAOYSA-N
ID: 95961
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -18.748
InChIKey:AIWWNGHRWHAXTF-UHFFFAOYSA-N
ID: 95962
SMILES:C1(C)=CCCC(=C)C2C(CC1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.427
CB1 binding score: -17.454
InChIKey:JOIGAAUCVYUZTJ-UHFFFAOYSA-N
ID: 95963
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)(O)C(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.502
InChIKey:YJXCCTXJUJKUKB-UHFFFAOYSA-N
ID: 95964
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 95965
SMILES:C(CCCC)c1cc(OC)c(CC=C(C)C)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.394
CB1 binding score: -17.614
InChIKey:LTIBHBYVOZPWPQ-UHFFFAOYSA-N
ID: 95966
SMILES:OCc1c(Cc2c(O)cccc2)cc(OC)c2c1OC(C)(C)C1C2C=C(CC2=CC(=O)C(C)(C)O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.623
CB1 binding score: -15.929
InChIKey:DEEMXDQKXFWBEK-UHFFFAOYSA-N
ID: 95967
SMILES:CC(C)C1CC(O)C(C)=CC1c1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.486
InChIKey:SDQWJJVWGRYCHO-UHFFFAOYSA-N
ID: 95968
SMILES:C(C(=CCc1c(O)cc(CCC)cc1O)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 95969
SMILES:c1(CCCCC)c(OC)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.335
InChIKey:JFWXWCXCACCYCO-UHFFFAOYSA-N
ID: 95970
SMILES:C(C1(C)CCC(C(O)(C)C)C(c2c(O)cc(CCCCC)cc2O)O1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.618
CB1 binding score: -15.621
InChIKey:CHLIMBODYJUYCP-UHFFFAOYSA-N