ID: 21190
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)C1=CCC(C)(O)C3C(=C(C)C=C3C(C)=CC1)C2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.576
CB1 binding score: -15.728
InChIKey:QMMVMSIGUTWTLW-UHFFFAOYSA-N
ID: 21191
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 21192
SMILES:OC1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(COC(=O)CC(C)(CC(=O)O)O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.593
CB1 binding score: -15.259
InChIKey:UQWHDRZCYNXNQG-UHFFFAOYSA-N
ID: 21193
SMILES:Oc1cc(O)c2c(c1C(=O)C(C)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 21194
SMILES:CC(N)Cc1cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 319.445
CB1 binding score: -14.184
InChIKey:FLAFADIKGPRJGN-UHFFFAOYSA-N
ID: 21195
SMILES:C(C=Cc1c2c(c(O)c(CC=C(C)C)c1O)OC(C)(C)C1C2C=C(C(O)=O)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -6.14
InChIKey:SUCRHHMZNNLTRV-UHFFFAOYSA-N
ID: 21196
SMILES:O1C2(Cc3c(O)cc(CCCCC)cc31)C1C(C(C)(C)O2)CCC(C)(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -14.793
InChIKey:FYSPUNQXLZZLGR-UHFFFAOYSA-N
ID: 21197
SMILES:C(C)(=C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 21198
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(COC(C)=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 21199
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C(=O)O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 21200
SMILES:O=C1C(C)CC2C(C)(C)Oc3c(c(OC)cc(C)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -13.229
InChIKey:VFACQQSVNBOIKW-UHFFFAOYSA-N
ID: 21201
SMILES:C(=C(C)C)CCC(=CCc1c(O)cc(CCCCC)c(O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.433
InChIKey:PQJHNORQVFURSH-UHFFFAOYSA-N
ID: 21202
SMILES:CC(CC(=O)c1c(O)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c1O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.326
InChIKey:ATWOHQVFQPURRA-UHFFFAOYSA-N
ID: 21203
SMILES:CC(COc1c(C(CC(C)C)=O)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.588
InChIKey:VYBCLKNIANKBBB-UHFFFAOYSA-N
ID: 21204
SMILES:c1(O)c2c(c(C(C)C(=O)CCC(C)C)c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.728
InChIKey:SHWSKORLZFYRMR-UHFFFAOYSA-N
ID: 21205
SMILES:C(=CCCC(C)=CCc1c(O)cc(C(O)CC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.47
InChIKey:OYTLZQMHMIZJEX-UHFFFAOYSA-N
ID: 21206
SMILES:O1C(C)(C(O)CCC(C)=CC(=O)CC(=CCc2c(OC)c(C)cc(O)c2)C)CC=CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.951
InChIKey:YSKDNOLYIKXKSU-UHFFFAOYSA-N
ID: 21207
SMILES:Oc1cc(O)c(CC=C(CCC=C(C)C)C)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 21208
SMILES:CC1(C)Oc2cc(CCCCC)c(O)c3c2C2C(CC1C(C)C2)C(C)CC3OC=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.827
InChIKey:PMDKBWIUEIGUEO-UHFFFAOYSA-N
ID: 21209
SMILES:C(CCC(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -14.605
InChIKey:UFXIKOITWODHLA-UHFFFAOYSA-N
ID: 21210
SMILES:O(C)c1c2c3c(c(C)c(CC=C(C)C)cc3o1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -12.029
InChIKey:WTVUERDFZPWWHG-UHFFFAOYSA-N