ID: 44941
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 44942
SMILES:CC1(C)Oc2c(c(O)c(C)c(O)c2C=O)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -16.363
InChIKey:QJOVEAFSOKRSFQ-UHFFFAOYSA-N
ID: 44943
SMILES:C(C1COC(=O)C1=C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -15.746
InChIKey:DUIMIMURXHYKAQ-UHFFFAOYSA-N
ID: 44944
SMILES:C12(c3c(cc(CCCCC)c(C(OC)=O)c3O)OC1)OC(CCC=C(C)C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -16.585
InChIKey:SXSCPUKSZMJMNB-UHFFFAOYSA-N
ID: 44945
SMILES:c1(CCCCC)cc2c(cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.502
InChIKey:KLPBLQQRVLSPKD-UHFFFAOYSA-N
ID: 44946
SMILES:C(CCCCCCCCCCCCc1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.739
CB1 binding score: -15.563
InChIKey:NRXYQIYKZMVVCS-UHFFFAOYSA-N
ID: 44947
SMILES:c1(C2C=C(C)CCC2C(=C)C)cc(O)c(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.701
InChIKey:GLWWBCAZFMPOBS-UHFFFAOYSA-N
ID: 44948
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 44949
SMILES:c1(CCCCC)cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 44950
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)c1cc(OC)c(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -19.709
InChIKey:VIPQCGARIOOKPX-UHFFFAOYSA-N
ID: 44951
SMILES:CC1(C)Oc2c(c(O)cc(C)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 44952
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CC=C(C)CCC=C(C)C)(O2)C(=O)C=C1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -17.334
InChIKey:CUCMOGYUDLSWHH-UHFFFAOYSA-N
ID: 44953
SMILES:O(C=O)C(=C)C1CCC2(C)Cc3c(cc(CCc4ccccc4)cc3O)OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -14.871
InChIKey:NIYGJDYDILTTHA-UHFFFAOYSA-N
ID: 44954
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1c2ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -18.541
InChIKey:DXDRGIVLXHOGHC-UHFFFAOYSA-N
ID: 44955
SMILES:C1C=C(C)CC2(O)C1(O)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.345
InChIKey:DLNWMBPQRRDOFG-UHFFFAOYSA-N
ID: 44956
SMILES:CC(CCCC(C)=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -17.054
InChIKey:YDEZBLGFVPGHEB-UHFFFAOYSA-N
ID: 44957
SMILES:C(=N)(CCO)c1c(CCCCC)cc2c(c1)OC(C)(C)C1CCC(C)C=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 369.549
CB1 binding score: -15.358
InChIKey:PMNBFCIPRNYYNC-UHFFFAOYSA-N
ID: 44958
SMILES:c1c(CCN)cc(O)c2c1OC(CCC=C(C)C)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 305.418
CB1 binding score: -15.929
InChIKey:CXINEDROQTUKNJ-UHFFFAOYSA-N
ID: 44959
SMILES:c1(C)cc(O)c2c(c1C)OC(C)C1CC(C)(CCC=C(C)C)C2CC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -12.045
InChIKey:LQFMLNJBJLMGLT-UHFFFAOYSA-N
ID: 44960
SMILES:c12cc3c(cc1OC2(C)CO)OC(C)(C)C1CC=C(C)CCC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.764
InChIKey:CMGKTNIRDVNEAO-UHFFFAOYSA-N
ID: 44961
SMILES:c1c(CCC(=O)C)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.206
InChIKey:UUZPMJGKYCRKLU-UHFFFAOYSA-N