ID: 84757
SMILES:C(CCCc1cc2c(c(O)c1)C1C(CC(O)C(C)=C1)C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.697
InChIKey:RDLUNEDCJHKYDQ-UHFFFAOYSA-N
ID: 84758
SMILES:C1C(C)(C)CC2(O)Oc3c(c(O)cc(CCCCC)c3)C2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.073
InChIKey:YIGSAIPPJLLVPK-UHFFFAOYSA-N
ID: 84759
SMILES:c1(C(C)C)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.72
InChIKey:MRWXCLDGBJQAHZ-UHFFFAOYSA-N
ID: 84760
SMILES:C(CCC)Cc1cc2c(c(O)c1C=O)CC1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -18.507
InChIKey:RURPVGLMCBORFF-UHFFFAOYSA-N
ID: 84761
SMILES:O=C1c2c(cc(CCCCC)cc2O)OC(C)(C)C2CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.678
InChIKey:YABJYMBYKNQWLC-UHFFFAOYSA-N
ID: 84762
SMILES:C1(C)=C2C(OC)(c3ccc(CCCCC)cc3)C(C(C)=C)C3C4CC4(C(=O)O3)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -16.368
InChIKey:IBDIQZVRLISERB-UHFFFAOYSA-N
ID: 84763
SMILES:c1(OC)cc2c(cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.112
InChIKey:OTSLLDNPLNAKHW-UHFFFAOYSA-N
ID: 84764
SMILES:C=C(C)C1CC=C(C)CC1c1c(OC(=O)C)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.78
InChIKey:ZIMGSXZIRNPFSE-UHFFFAOYSA-N
ID: 84765
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 84766
SMILES:c1(CCCCCO)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.669
InChIKey:WMDIVYZKMBVAFJ-UHFFFAOYSA-N
ID: 84767
SMILES:C(c1c(O)c(C)c(O)c2c1CC1C(C(C)(C)c3cc4c(c(O)c3o1)CC1CC(O)C(C)(C)OC1(C)C4=O)O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.664
CB1 binding score: -16.963
InChIKey:AXHAFLWJLIQFNC-UHFFFAOYSA-N
ID: 84768
SMILES:C1(=O)c2c(cc(CCCCC)cc2O)OC(C)(C)C2CCC(C)(O)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.227
InChIKey:LFFCDSSOJOMTRX-UHFFFAOYSA-N
ID: 84769
SMILES:C1(CCC=C(C)C)(C)Oc2c(c(O)cc(CCCCCC)c2)-c2cc(OC)c3c(c21)OC(C)(C)C=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.684
CB1 binding score: -13.726
InChIKey:DDVJRHFCOLSSIZ-UHFFFAOYSA-N
ID: 84770
SMILES:Oc1c(OC)cc(C=CC(CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2)=O)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.59
CB1 binding score: -10.852
InChIKey:LNLYGRKPMQOYEY-UHFFFAOYSA-N
ID: 84771
SMILES:C(CCCC)CCCCCCCCCCCCc1cc2c(c(O)c1C(O)=O)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.802
CB1 binding score: -15.836
InChIKey:NXZDRANSZXCMHE-UHFFFAOYSA-N
ID: 84772
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 84773
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(O)(C)C21)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.719
InChIKey:ZECUJFAOTDACEL-UHFFFAOYSA-N
ID: 84774
SMILES:OC1(C)CCC2=C1c1c(cc(CCCCC)cc1O)OC(C)(C)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.058
InChIKey:QGKZQLNUCYARIT-UHFFFAOYSA-N
ID: 84775
SMILES:OC(Cc1c(O)cc(CCCCC)c(C(=O)O)c1O)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.619
InChIKey:MEMAQNFHVUBQFB-UHFFFAOYSA-N
ID: 84776
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)CO1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.859
InChIKey:OXAVKQRFGYZUPI-UHFFFAOYSA-N
ID: 84777
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N