ID: 141982
SMILES:O=C1C(C)CCC12c1c(O)cc(CCCCC)cc1OC2(CO)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.488
InChIKey:QQABADJQYFGRST-UHFFFAOYSA-N
ID: 141983
SMILES:c1(CCCCC)c(C(=O)O)c(O)c(C2C=C(C)CCC2C(C)=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.254
InChIKey:JOPQKPPHUKRTAG-UHFFFAOYSA-N
ID: 141984
SMILES:c1c(C2=CC(C)=CC(C)(C)C2)c(O)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -14.428
InChIKey:SWIFSVPMFDRBRX-UHFFFAOYSA-N
ID: 141985
SMILES:O=C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC21)C=CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.577
InChIKey:MXKHTDVUOMSLAI-UHFFFAOYSA-N
ID: 141986
SMILES:COc1cc(C(=O)OCCCC)c(O)c2c1-c1c(cc(CCCCCC)cc1OC)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -14.681
InChIKey:QXHLAMNMZLNRLP-UHFFFAOYSA-N
ID: 141987
SMILES:C(C=C(C)C)c1c(O)c(C(=O)OC)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -17.629
InChIKey:XEUWUHXAAAQAQY-UHFFFAOYSA-N
ID: 141988
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)OC)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.504
InChIKey:IHPFHCNIOINQJQ-UHFFFAOYSA-N
ID: 141989
SMILES:C12(C(=O)OC)C(CC3(C)C(C)(C1C)O3)c1c(O)cc(C)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -12.969
InChIKey:UEXHTTAWZWQRBB-UHFFFAOYSA-N
ID: 141990
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 141991
SMILES:c1(C2C(C(=C)C(CCC(=O)C)C)CCC(C)=C2)cc(O)ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.849
InChIKey:WDLZZEKNPTVMFP-UHFFFAOYSA-N
ID: 141992
SMILES:OCC1Oc2cc(CCCCC)cc(O)c2C1C(C(C)C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -11.517
InChIKey:SPOZKPUEEXKMIG-UHFFFAOYSA-N
ID: 141993
SMILES:C(Nc1c(C(C)C2=C(C)CCCC2)c(O)cc(CCCCC)c1)(O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.483
CB1 binding score: -13.522
InChIKey:CQRZFYUPIIFZHI-UHFFFAOYSA-N
ID: 141994
SMILES:C(C)c1c(O)cc(CC=C(C)CCC=C(C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -15.552
InChIKey:VVRIXIZMNYHIHL-UHFFFAOYSA-N
ID: 141995
SMILES:C1(O)C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.238
InChIKey:BJYXQJGARPKCEI-UHFFFAOYSA-N
ID: 141996
SMILES:Oc1c(CC=C(CC(OC(=O)C)C=C(C)CCC=C(C)C)C)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 414.586
CB1 binding score: -16.123
InChIKey:LVHBYERQCYDPRA-UHFFFAOYSA-N
ID: 141997
SMILES:C(=CCC)Cc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.758
InChIKey:OVCZNZVSBITCSP-UHFFFAOYSA-N
ID: 141998
SMILES:C1CC(C)=CC(c2c(O)cc(CCCCC)cc2OC)C1C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -17.795
InChIKey:ADAXZBRDQCTCQY-UHFFFAOYSA-N
ID: 141999
SMILES:O=C(c1c(O)c(C2C=C(C)CCC2C(C)C)c(OC)cc1CCCCC)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.321
InChIKey:PYSLUYIXGWBBJS-UHFFFAOYSA-N
ID: 142000
SMILES:Oc1cc(O)cc(CCC2(C)C(C)=CCCC2C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.332
InChIKey:INEZRSRCOPDSLB-UHFFFAOYSA-N
ID: 142001
SMILES:C1C2(O)C(CC1(C)C)c1c(cc(CCCCC)cc1O)OC(C)(C)CC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -13.15
InChIKey:RIYPYYCKZSDHRQ-UHFFFAOYSA-N
ID: 142002
SMILES:CCCC(=O)c1c(O)c2c(cc1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.372
InChIKey:RTEWCYABTDILHO-UHFFFAOYSA-N