ID: 62728
SMILES:C(c1c2c(c(O)c(C)c1O)OC(C)(C)C1CCC(C)=CC21)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.423
InChIKey:IUBVCPHFIXNMBF-UHFFFAOYSA-N
ID: 62729
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 62730
SMILES:C1C(C)=CC2C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 62731
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 62732
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC1=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -15.909
InChIKey:QMEPFFOQLRIVEW-UHFFFAOYSA-N
ID: 62733
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)C(O)CC1(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.031
InChIKey:KGHSYVLXFKQLFA-UHFFFAOYSA-N
ID: 62734
SMILES:CC1(O)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.762
InChIKey:ICMJYQRNULRNTK-UHFFFAOYSA-N
ID: 62735
SMILES:CC(=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 62736
SMILES:CC1(C)C2CC=C(C(O)=O)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 62737
SMILES:CC1(C)Oc2c(O)c(C(c3ccccc3)=O)c(OC)cc2OC2c3c(c(CCCC(C)CC(CC(C)C)O)c(C)cc3O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 602.768
CB1 binding score: -16.015
InChIKey:KELKHORABLCIOO-UHFFFAOYSA-N
ID: 62738
SMILES:c1(C(C(C)CC)=O)c2c(c(O)c(C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.937
InChIKey:BHMBBIVDTVQQHT-UHFFFAOYSA-N
ID: 62739
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1(C)CCC1C(COC(=O)CCC)(C)CCCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -14.374
InChIKey:YVJKZEOTVQKLPW-UHFFFAOYSA-N
ID: 62740
SMILES:C1(=C)CCC2C(C)(C)Oc3c(c(O)cc(CCCC)c3)C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.913
InChIKey:NEVYBJVSWZLBLS-UHFFFAOYSA-N
ID: 62741
SMILES:CC1=CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.096
InChIKey:OPOIPENSMKDQLW-UHFFFAOYSA-N
ID: 62742
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.715
InChIKey:POGJSPFSYBEGJI-UHFFFAOYSA-N
ID: 62743
SMILES:C(CCc1c2c(cc(O)c1)C1C=C(C)C(O)CC1C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.63
InChIKey:AILPQZCIAVPUBI-UHFFFAOYSA-N
ID: 62744
SMILES:C1=C(C)CCC=C(C)CCC2C(C)(C)Oc3cc(CCC)cc(O)c3C2(O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.522
InChIKey:QQYHUAJXZACUHC-UHFFFAOYSA-N
ID: 62745
SMILES:C1C2C1C(C=CC)c1c(OC)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.978
InChIKey:KJYKBMWRZSKWNO-UHFFFAOYSA-N
ID: 62746
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 62747
SMILES:O1c2c(c(O)cc(CCC)c2)C2CC(C)=CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 62748
SMILES:O=C1C(C)=CCC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.792
InChIKey:SJZVNVPYZDSYFZ-UHFFFAOYSA-N