ID: 6868
SMILES:C(CCCC(=O)OC1C(OC(C)=O)C2C(C)(C)OC3(c4c(cc(C)cc4O)O1)C2C3)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.513
CB1 binding score: -17.46
InChIKey:SRRAAWFOPLIMQS-UHFFFAOYSA-N
ID: 6869
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C1OC(=O)CC1CCC(=C)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.742
CB1 binding score: -14.323
InChIKey:ANWDUVXAIHPMPH-UHFFFAOYSA-N
ID: 6870
SMILES:c1(O)c2c(cc(CCCCC)c1CC(OCC)OCC)OC(C)(C)C1CC=C(C)C(=O)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -11.762
InChIKey:PJAOYKVHVSCVCH-UHFFFAOYSA-N
ID: 6871
SMILES:c1c(C(CCCCCCC)C)cc2c(c1)OC(C)(C)C1CCC(C(=O)OC)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.721
InChIKey:CWBALKOFYCPIMG-UHFFFAOYSA-N
ID: 6872
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CC(C)(CCCC(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -14.022
InChIKey:SQFNJSNSXXKHQJ-UHFFFAOYSA-N
ID: 6873
SMILES:C1C=C(C)CCC=C(C)CCC2C(C)(C)Oc3c(ccc(C)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -17.222
InChIKey:YALMBXFIITWVRH-UHFFFAOYSA-N
ID: 6874
SMILES:C1C2C(C)(C)Oc3cc(C)ccc3C23C(C(C)=CC3=O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.355
CB1 binding score: -15.342
InChIKey:XCAWOIIWZJMDRS-UHFFFAOYSA-N
ID: 6875
SMILES:C1C2(c3c(cc(CCCCC)c(C(OC)=O)c3O)OC2OC)C(C=C(C)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -13.54
InChIKey:PTZPEUZIWNNDEB-UHFFFAOYSA-N
ID: 6876
SMILES:c1(CCCC)c(C(OC)=O)c(CCCCC)c2c3c1OC(C)(C)C1CCC(C)(C=C31)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.625
InChIKey:GMKBNVOIXBPSII-UHFFFAOYSA-N
ID: 6877
SMILES:CCCCCCc1cc2c(c(O)c1)C1C(CCC(O)(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.427
InChIKey:UTXVBEHMQGNODO-UHFFFAOYSA-N
ID: 6878
SMILES:CC1(C)C2C(CC(O)(C)CC2)c2c(cc(CCCCC)cc2O)CO1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: Not available
InChIKey:ZARZOENQWZOPCQ-UHFFFAOYSA-N
ID: 6879
SMILES:Oc1c(C)c(=O)c(C)c2c(c1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.929
InChIKey:SMHBQUAZLAZJEU-UHFFFAOYSA-N
ID: 6880
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)C=C1)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.951
InChIKey:DBNPFOHJYPFYSG-UHFFFAOYSA-N
ID: 6881
SMILES:Cc1c(C2(C)CC(C)(C)CCC2)cc(CCc2cc(O)c(CC=C(C)C)c(O)c2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -15.929
InChIKey:PTWFQASEPJASRA-UHFFFAOYSA-N
ID: 6882
SMILES:C1C2C(C)(C)Oc3cc(CCCC(CCCO)O)cc(O)c3C2C(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.509
CB1 binding score: -16.011
InChIKey:RQBHNFOUMUOYSR-UHFFFAOYSA-N
ID: 6883
SMILES:COc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.978
InChIKey:DLAZOUMHGLLKMO-UHFFFAOYSA-N
ID: 6884
SMILES:Oc1c(C(C(CC)C)=O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 6885
SMILES:CC(C)C1CCC(O)(C)C(O)C1c1c(O)cc(CCCCC)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.5
CB1 binding score: -15.567
InChIKey:XVPXZGGOXRSIQI-UHFFFAOYSA-N
ID: 6886
SMILES:c1(OC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.286
InChIKey:VBGLQLUQKZRKHZ-UHFFFAOYSA-N
ID: 6887
SMILES:c1(C=O)c(O)c(C(CC(C)C)=O)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 372.461
CB1 binding score: -17.581
InChIKey:JFADHCMLMYPJCV-UHFFFAOYSA-N
ID: 6888
SMILES:CC(C1C(c2c(O)cc(CCCC(O)C)cc2O)CC(C)=CC1=O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.091
InChIKey:ZFWRUJBIYOEIPT-UHFFFAOYSA-N