ID: 85513
SMILES:CC(C(=O)Oc1c2c(cc(C)c1)OC(C)(C)C1=CC=C(C=O)CC1C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -14.254
InChIKey:USXCVBQCLCYPOS-UHFFFAOYSA-N
ID: 85514
SMILES:C1C(C)CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -21.078
InChIKey:LXIXAVCVBZBXIY-UHFFFAOYSA-N
ID: 85515
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(CCC1(C)CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.767
InChIKey:LIDVKVLNWQWNOS-UHFFFAOYSA-N
ID: 85516
SMILES:C(CCCc1cc(O)c(CC=C(CCC(C(=C)C)O)C)cc1O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.154
InChIKey:AEMOIZNDAKOWAW-UHFFFAOYSA-N
ID: 85517
SMILES:C1C2c3c(cc(CCCCC)cc3O1)OC(C)(C)C1C2C=C(C(OC)=O)CCC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -15.098
InChIKey:ICRCBRDRMKOVDX-UHFFFAOYSA-N
ID: 85518
SMILES:CC1=CC2c3c(c(Cl)c(O)cc3C)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.806
CB1 binding score: -16.155
InChIKey:AQNCHHPQSUMOGJ-UHFFFAOYSA-N
ID: 85519
SMILES:C1CC2C(C)(C)Oc3c(c(OC(=O)C)ccc3)C2CC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -12.907
InChIKey:FFQRWHMTTHTEPQ-UHFFFAOYSA-N
ID: 85520
SMILES:CC1(C)C=Cc2c(cc(CCCCC)c(C(=O)O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -18.748
InChIKey:AIWWNGHRWHAXTF-UHFFFAOYSA-N
ID: 85521
SMILES:O=Cc1c(C=O)c(O)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -15.848
InChIKey:MQCVLLMNWVOINE-UHFFFAOYSA-N
ID: 85522
SMILES:C1(C)CCC(C(O)(C)C)=CCC2(C)Oc3c(c(O)cc(CCCCCCOC(=O)C)c3)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.502
InChIKey:QJJCZQAEOFVGFC-UHFFFAOYSA-N
ID: 85523
SMILES:CC(=C)C1CCC(C)C=C1c1c(O)cc(CCCCC)c(OC(=O)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.254
InChIKey:UXJNMYHTVNGPFG-UHFFFAOYSA-N
ID: 85524
SMILES:O=C(C)OCC(CCC=C(C)C)=CCc1c(O)c(C(=O)OC)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -16.169
InChIKey:YBLDHIONCUNBRS-UHFFFAOYSA-N
ID: 85525
SMILES:C1(=O)CC(C)C2(C)Cc3c(O)c(C(OC)=O)c(CCCCC)cc3OC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.769
InChIKey:MKRLAWVPZNIVSE-UHFFFAOYSA-N
ID: 85526
SMILES:Oc1cc(CCC(C)O)cc2c1C1CC(C=O)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: Not available
InChIKey:SFEAECSCZPSQJN-UHFFFAOYSA-N
ID: 85527
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 85528
SMILES:O1c2c(cc(C)c(CCC(C)(O)C)c2)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -12.649
InChIKey:FPNNONBSMDOIEK-UHFFFAOYSA-N
ID: 85529
SMILES:O1C(C)(C)C2CCC(C)=CC2c2c(C)ccc(C(C)C)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -18.046
InChIKey:ARWRFFJFUABHRJ-UHFFFAOYSA-N
ID: 85530
SMILES:C12c3c(O)cc(C(C(C)C)=O)c(O)c3OC(C)(C)C1CCC(C)(O)C2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.438
CB1 binding score: -14.686
InChIKey:SEURHBBJSVWKCA-UHFFFAOYSA-N
ID: 85531
SMILES:C(CCC(C)CC)c1cc(C2C=C(C)CCC2C(C)C)c(O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -17.527
InChIKey:XRRMLNSFKJDDAY-UHFFFAOYSA-N
ID: 85532
SMILES:CC12C3C(c4c(cc(CCCCC)cc4OC)O1)C(C)(C)C3C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.568
InChIKey:KUJHVPXCHWWHQH-UHFFFAOYSA-N
ID: 85533
SMILES:O=c1cc2c(c(CC)cc1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -14.826
InChIKey:VPBOAIUPVHBCOU-UHFFFAOYSA-N