ID: 94711
SMILES:O=C1C(CO)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.174
InChIKey:CJRHYYRYCGLADH-UHFFFAOYSA-N
ID: 94712
SMILES:Cc1ccc2c(c1)C(C)(C)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -15.929
InChIKey:DHOLHIPKCXHZOL-UHFFFAOYSA-N
ID: 94713
SMILES:c1(CC=C(CCC=C(C)C)C)c(CCCCC)cc(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 94714
SMILES:C(CC)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.624
InChIKey:RRQVSLLVCGRJNI-UHFFFAOYSA-N
ID: 94715
SMILES:c1(CCCC)cc2c(c(O)c1)C1C(CC=C(C)C)(O1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.595
InChIKey:NFSUSQMENGFECX-UHFFFAOYSA-N
ID: 94716
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 94717
SMILES:C12C(c3c(O)cc(CCCCC)cc3O1)C(C(=C)C)CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -18.683
InChIKey:XEQKLVXQJCBVCP-UHFFFAOYSA-N
ID: 94718
SMILES:CCCCC(CC)CC(C)(C)c1c(O)cc(O)c2c1OC(C)(C)C1CCC(C)(O)C=C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -15.734
InChIKey:YRHHHOQNFSRAJR-UHFFFAOYSA-N
ID: 94719
SMILES:C(c1cc(CCC(C(=C)CCC=C(C)C)C)cc(O)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -12.73
InChIKey:KXMFACSYYYTWEY-UHFFFAOYSA-N
ID: 94720
SMILES:CCCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 94721
SMILES:CC1(C)Oc2c(c(O)cc(CC=C)c2)C2C1CCC(=C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -15.966
InChIKey:APRYSSNIVLNQNN-UHFFFAOYSA-N
ID: 94722
SMILES:c1(C(C)(Cc2cc(CCCCC)ccc2)O)ccc(O)c(C2C(C(C)=C)CCC(C)=C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -15.157
InChIKey:LGEWCTWERUMKMI-UHFFFAOYSA-N
ID: 94723
SMILES:C(C1C=Cc2c(cc(CCCCC)cc2O)O1)C(C(C)=C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.933
InChIKey:BCIUZLNYABHJHG-UHFFFAOYSA-N
ID: 94724
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 94725
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c32)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.469
CB1 binding score: -16.146
InChIKey:UGFAENRHJIKCCC-UHFFFAOYSA-N
ID: 94726
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(=O)O)CC12)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.464
InChIKey:GCKMTONETSXIJS-UHFFFAOYSA-N
ID: 94727
SMILES:CCCCCc1cc(O)c(C2C=C(C)C(O)CC3C(C)(C)C(=O)CCC32C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -13.925
InChIKey:MWQLQAWXDSACGO-UHFFFAOYSA-N
ID: 94728
SMILES:CC1=CC2CC(C)(C)CC13c1c(cc(CCCCC)cc1O)OC32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.22
InChIKey:KQWDXAVQSWNLAW-UHFFFAOYSA-N
ID: 94729
SMILES:C1(=CC)C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -19.311
InChIKey:FWZCDDCJAWMEEK-UHFFFAOYSA-N
ID: 94730
SMILES:C(CC(=CCc1c(O)cc(CCCCC)c(OC)c1O)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.615
InChIKey:RBAMEMWAPDBZPD-UHFFFAOYSA-N
ID: 94731
SMILES:C1(CO)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N