ID: 50821
SMILES:C12C(c3c(cc(CCCCC)c(C(=O)O)c3O)OC1(C)C)C(C)CCC2C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.254
InChIKey:NMDMVALOYYLAKH-UHFFFAOYSA-N
ID: 50822
SMILES:C1(O)C(C(C)C)CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C12OO3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -12.675
InChIKey:VNQATNXILFZNIO-UHFFFAOYSA-N
ID: 50823
SMILES:C(C1C(c2c(O)c(C(OC)=O)c(CCCCC)cc2)C(C(C)=C)CC1)CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.072
InChIKey:GEDVSWKGEPOTAM-UHFFFAOYSA-N
ID: 50824
SMILES:O1c2cc(CCCC)cc(O)c2C2C3=C(CCC(C(C)=C)C13C)C(C)=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -14.428
InChIKey:HABBAYFPVQOZKJ-UHFFFAOYSA-N
ID: 50825
SMILES:c12cc(CCCCC)ccc1OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.54
InChIKey:QBKRMPHNODAHEZ-UHFFFAOYSA-N
ID: 50826
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 50827
SMILES:C(C(=CCCC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O)C)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 50828
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C=C(C)CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 298.426
CB1 binding score: -16.015
InChIKey:LJQUYNMLFYFVSA-UHFFFAOYSA-N
ID: 50829
SMILES:C1(O)C(C)=CC2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 50830
SMILES:C(CCc1cc(OC)c2c(c1)OC(C)(C)C1CC(O)C(C)(O)CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -12.217
InChIKey:AMJGJHFVUPGPSC-UHFFFAOYSA-N
ID: 50831
SMILES:CC1=CC2C(C(C)(C)Oc3cc(C)c(O)cc32)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 272.344
CB1 binding score: -17.952
InChIKey:CLFHOLPMPFYSHV-UHFFFAOYSA-N
ID: 50832
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 50833
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C(O)CCC(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -16.308
InChIKey:FAJVAMFHHOARLO-UHFFFAOYSA-N
ID: 50834
SMILES:c1(O)c(C=O)c(CCC)cc2c1C1C(CCC(COC(CCC(O)=O)=O)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -15.549
InChIKey:WSOSFAHUXFFTDZ-UHFFFAOYSA-N
ID: 50835
SMILES:c1(O)c(C(C(C)C)=O)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 50836
SMILES:c1(C(C)C(CC)=O)cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -16.702
InChIKey:YVZKXAXRVFMTEW-UHFFFAOYSA-N
ID: 50837
SMILES:C12C(C)(C)Oc3cc(CO)cc(O)c3C1C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.796
InChIKey:XAGPVCMEKIDKRZ-UHFFFAOYSA-N
ID: 50838
SMILES:C(c1c(OC)c(C2C=C(C)CCC2C(=C)C)c(OC)cc1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -14.558
InChIKey:MCTOBUKOVASIOV-UHFFFAOYSA-N
ID: 50839
SMILES:C(CC)CCCc1cc2c(c(O)c1)OC1C2(C)CC(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.221
InChIKey:KUOGDMPIZMNJLJ-UHFFFAOYSA-N
ID: 50840
SMILES:C12(C)CCCC(C)(CO)C1C(=O)CC1CC21c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -11.802
InChIKey:RELRYTBAJSWVPK-UHFFFAOYSA-N
ID: 50841
SMILES:c1(CCCCC)cc(O)cc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N