ID: 61195
SMILES:C12CC(C)(Oc3cc(CCCCCC)cc(O)c31)C(=O)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.187
InChIKey:XGDVDDLOARUNHL-UHFFFAOYSA-N
ID: 61196
SMILES:C1=C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.455
InChIKey:WODRTIUMYOLLLU-UHFFFAOYSA-N
ID: 61197
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 61198
SMILES:C1=Cc2c(cc(CCCCC)cc2O)OC1(CC=C(CCC=C(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -18.826
InChIKey:OFFQFODLSXRVJX-UHFFFAOYSA-N
ID: 61199
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CC=CC(=CC(=CC(C(=O)OC)C)C)C)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -15.725
InChIKey:BSLBJNLFAQODLR-UHFFFAOYSA-N
ID: 61200
SMILES:C1=C(C)CCC(C(O)(C)C)C1c1c(O)cc(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.141
InChIKey:HEEJEKKEYJPCFA-UHFFFAOYSA-N
ID: 61201
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 61202
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 61203
SMILES:C=C(C)C1C(c2c(O)cc(CCCCC)cc2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.481
InChIKey:YGQOYJUFZSNESF-UHFFFAOYSA-N
ID: 61204
SMILES:O=C(C)Oc1c(O)c2c(cc1CCCCC)OC(C)(CCC=C(CCC=C(C)C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.382
InChIKey:QXBOWHYJQISLNZ-UHFFFAOYSA-N
ID: 61205
SMILES:C(C)CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 61206
SMILES:Cc1c(OC(=O)CCC)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.597
InChIKey:PYGFJMRYTJHYGQ-UHFFFAOYSA-N
ID: 61207
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CC(O)C(O)(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.774
InChIKey:GKYGKYSJIDSYCQ-UHFFFAOYSA-N
ID: 61208
SMILES:C(CCC)Cc1cc(O)c2c(c1OC1OC(CO)C(O)C(O)C1O)OC(C)(C)C1CCC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.608
CB1 binding score: -13.985
InChIKey:IXSZJHKTBGANFV-UHFFFAOYSA-N
ID: 61209
SMILES:C(C1=CCc2c(O)cc(CCCCC)c(O)c2C1CC(C)=C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.929
InChIKey:DWPZNWFRPQKEAA-UHFFFAOYSA-N
ID: 61210
SMILES:c12c3c(ccc1CC(C)(C)CCC2)-c1c(O)cc(CCCCC)cc1OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.583
CB1 binding score: -12.424
InChIKey:MSTRIFCIXVUDHU-UHFFFAOYSA-N
ID: 61211
SMILES:c1(O)cc2c(c(CC=C(CO)C)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.178
InChIKey:IVRGJKQGVHVHPP-UHFFFAOYSA-N
ID: 61212
SMILES:C(CCC(=CCCC1(C)Oc2ccc(O)cc2C2=C1CC(O)C(C)(C)C2)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.664
InChIKey:NDJVDHDUEXULQN-UHFFFAOYSA-N
ID: 61213
SMILES:c12c(O)c(C(O)=O)c(CCCCC)cc1OC(C)(C)C1CCC(O)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -16.218
InChIKey:OETIPCSFBZREHY-UHFFFAOYSA-N
ID: 61214
SMILES:Oc1cc2c(cc1C)OC(C)(C)C1CC=C(COC(=O)C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.072
InChIKey:ITPRLIPDMJBWJX-UHFFFAOYSA-N
ID: 61215
SMILES:O=C(O)c1c(O)c2c(c(Cl)c1C)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.815
CB1 binding score: -14.935
InChIKey:SUSHAZCDJGTLFH-UHFFFAOYSA-N